SCHEMBL4287080

SCHEMBL4287080

CCOc1ccc(CCCCCOc2ccc(CNC3CCC(C(=O)O)(C(=O)O)C3)cc2)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 8/20 0.40
PPARG P37231 7/20 0.40
PPARD Q03181 2/20 0.40
LTB4R Q15722 2/20 0.39
LTB4R2 Q9NPC1 2/20 0.39
CNR1 P21554 3/20 0.39
CNR2 P34972 3/20 0.39
ACACB O00763 1/20 0.37
FFAR1 O14842 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
OPRK1 P41145 1/20 0.36
KMT2A Q03164 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13659717 0.99 PPARA (0.40) PPARAPPARGPPARDLTB4RLTB4R2
Hydrochloric Acid SCHEMBL4296373 0.98 PPARA (0.40) PPARAPPARGPPARDLTB4RLTB4R2
SCHEMBL4289141 0.91 PPARA (0.39) PPARAPPARGPPARDLTB4RLTB4R2
Hydrochloric Acid SCHEMBL4633607 0.88 PPARA (0.39) PPARAPPARGPPARDLTB4RLTB4R2
SCHEMBL5800345 0.85 S1PR1 (0.47) PPARAPPARDLTB4RLTB4R2
SCHEMBL13659714 0.85 HRH3 (0.34) PPARAPPARDCNR1CNR2FFAR1
SCHEMBL5795188 0.85 S1PR1 (0.43) CNR1CNR2MEN1KMT2A
SCHEMBL4287826 0.85 S1PR2 (0.49) PPARAPPARGCNR1CNR2MEN1
SCHEMBL4294265 0.85 S1PR2 (0.49) PPARAPPARGCNR1CNR2MEN1
SCHEMBL4289431 0.85 S1PR2 (0.49) PPARAPPARGCNR1CNR2MEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090264469-A1 NOVEL DICARBOXYLIC ACID DERIVATIVES BIO-PROJET (FR) 2009-10-22 US claimed
US-20090264469-A1 NOVEL DICARBOXYLIC ACID DERIVATIVES BIO-PROJET (FR) 2009-10-22 US disclosed
US-20090264469-A1 NOVEL DICARBOXYLIC ACID DERIVATIVES BIO-PROJET (FR) 2009-10-22 US disclosed
US-20090264469-A1 NOVEL DICARBOXYLIC ACID DERIVATIVES BIO-PROJET (FR) 2009-10-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090264469-A1 NOVEL DICARBOXYLIC ACID DERIVATIVES S1PR2, S1PR1, S1PR5 PPARA 357/4885PPARG 478/4885PPARD 189/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.